{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.7826629 0.079664 0.3147899 ] [ 0.4004832 1.295186 0.8087518 ] [ 0.7320587 0.6290848 2.788823 ] [ 1.344916 2.662801 0.2560168 ] [ 0.3963272 2.667865 2.000738 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.826629000000001e-11 7.9664e-12 3.147899e-11 ] [ 4.004832e-11 1.295186e-10 8.087518e-11 ] [ 7.320586999999999e-11 6.290848000000001e-11 2.788823e-10 ] [ 1.344916e-10 2.662801e-10 2.560168e-11 ] [ 3.963272e-11 2.667865e-10 2.000738e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 16.4786828 -58.4144974 -25.0665058 ] [ -27.0305939 25.9196702 12.3972819 ] [ 0.5050332 -4.657273 7.8334406 ] [ 14.9952578 18.3135976 -15.1003407 ] [ -4.94838 18.8385026 19.936124 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.640176032373909e-08 -9.359034205006239e-08 -4.016096955790761e-08 ] [ -4.330778559291909e-08 4.152788961328646e-08 1.9862635221647e-08 ] [ 8.091523857678106e-10 -7.461773917283079e-09 1.255055538974552e-08 ] [ 2.402505147002884e-08 2.934161791745899e-08 -2.419341283565471e-08 ] [ -7.928178746834304e-09 3.018260843660002e-08 3.194119178216978e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 22.620176 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.624151714558126e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.0720292 -0.0962664 -0.1136844 ] [ 0.7313099 1.4669244 1.2338333 ] [ 1.6259175 0.512492 3.0208577 ] [ 2.2808148 2.6357774 0.1672795 ] [ -0.909565 2.8156733 1.8608334 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -7.202920000000001e-12 -9.62664e-12 -1.136844e-11 ] [ 7.313099e-11 1.4669244e-10 1.2338333e-10 ] [ 1.6259175e-10 5.124919999999999e-11 3.0208577e-10 ] [ 2.2808148e-10 2.6357774e-10 1.672795e-11 ] [ -9.09565e-11 2.8156733e-10 1.8608334e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.96e-05 -3.04e-05 -2.44e-05 ] [ -5.07e-05 -2.3e-06 -9.9e-06 ] [ 5.33e-05 2.6e-05 -9.4e-06 ] [ 4.85e-05 -4.2e-06 4.09e-05 ] [ -2.14e-05 1.09e-05 2.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.742442797568e-14 -4.870616927232e-14 -3.909310954752e-14 ] [ -8.123035467456e-14 -3.68500622784e-15 -1.586154854592e-14 ] [ 8.539601388864e-14 4.16565921408e-14 -1.506046023552e-14 ] [ 7.77055661088e-14 -6.72914180736e-15 6.552902379072e-14 ] [ -3.428657968511999e-14 1.746372516672e-14 4.48609453824e-15 ] ] } "relaxed-potential-energy" { "source-value" -8.4151533 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.348256187770797e-18 } }